CHEBI:27428 - 3α,7α-dihydroxy-5β-cholestan-26-al

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ChEBI Name 3α,7α-dihydroxy-5β-cholestan-26-al
ChEBI ID CHEBI:27428
ChEBI ASCII Name 3alpha,7alpha-dihydroxy-5beta-cholestan-26-al
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:1706, CHEBI:20231
Supplier Information
Download Molfile XML SDF
Formula C27H46O3
Net Charge 0
Average Mass 418.65234
Monoisotopic Mass 418.34470
InChI InChI=1S/C27H46O3/c1-17(16-28)6-5-7-18(2)21-8-9-22-25-23(11-13-27(21,22)4)26(3)12-10-20(29)14-19(26)15-24(25)30/h16-25,29-30H,5-15H2,1-4H3/t17?,18-,19+,20-,21-,22+,23+,24-,25+,26+,27-/m1/s1
InChIKey YWGOKHMOJTZGBN-UGMUFZQESA-N
SMILES [H]C(=O)C(C)CCC[C@@H](C)[C@@]1([H])CC[C@@]2([H])[C@]3([H])[C@H](O)C[C@]4([H])C[C@H](O)CC[C@]4(C)[C@@]3([H])CC[C@]12C
Metabolite of Species Details
Mus musculus (NCBI:txid10090) Source: BioModels - MODEL1507180067 See: PubMed
Homo sapiens (NCBI:txid9606) See: DOI
Roles Classification
Biological Role(s): human metabolite
Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
mouse metabolite
Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 3α,7α-dihydroxy-5β-cholestan-26-al (CHEBI:27428) has parent hydride 5β-cholestane (CHEBI:35517)
3α,7α-dihydroxy-5β-cholestan-26-al (CHEBI:27428) has role human metabolite (CHEBI:77746)
3α,7α-dihydroxy-5β-cholestan-26-al (CHEBI:27428) has role mouse metabolite (CHEBI:75771)
3α,7α-dihydroxy-5β-cholestan-26-al (CHEBI:27428) is a 26-oxo steroid (CHEBI:36884)
3α,7α-dihydroxy-5β-cholestan-26-al (CHEBI:27428) is a 3α-hydroxy steroid (CHEBI:36835)
3α,7α-dihydroxy-5β-cholestan-26-al (CHEBI:27428) is a 7α-hydroxy steroid (CHEBI:36843)
3α,7α-dihydroxy-5β-cholestan-26-al (CHEBI:27428) is a steroid aldehyde (CHEBI:131565)
IUPAC Name
3α,7α-dihydroxy-5β-cholestan-26-al
Synonyms Sources
3alpha,7alpha-dihydroxy-5beta-cholestan-26-al ChEBI
3alpha,7alpha-Dihydroxy-5beta-cholestan-26-al KEGG COMPOUND
Manual Xref Database
C05445 KEGG COMPOUND
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Last Modified
17 March 2016